SCHEMBL23575459

SCHEMBL23575459

CCOC(=O)c1cnc2cc(F)c(Br)cc2c1NC12CC(C1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPK1 P28482 2/20 0.46
MAPT P10636 5/20 0.44
TP53 P04637 1/20 0.44
NPSR1 Q6W5P4 3/20 0.44
RXFP1 Q9HBX9 3/20 0.44
GAA P10253 3/20 0.44
CA2 P00918 1/20 0.43
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AURKB Q96GD4 2/20 0.41
THRB P10828 1/20 0.41
AURKA O14965 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 1/20 0.39
PAX8 Q06710 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23575542 0.84 JAK2 (0.39) KDM4EALDH1A1
SCHEMBL23575790 0.84 NUDT1 (0.41)
SCHEMBL23575679 0.83 MAPK1 (0.52) MEN1KMT2AMAPK1MAPTTP53
SCHEMBL18844631 0.81 PDE4B (0.56) MEN1KMT2AMAPK1MAPTTP53
SCHEMBL18631958 0.81 GAA (0.53) MEN1KMT2AMAPK1MAPTTP53
SCHEMBL17246443 0.80 PDE4B (0.49) MEN1KMT2AMAPK1MAPTTP53
SCHEMBL23575784 0.80 EGFR (0.39) HPGDL3MBTL1
SCHEMBL17246414 0.79 PDE4B (0.62) MEN1KMT2AMAPTNPSR1RXFP1
SCHEMBL17243253 0.79 JAK1 (0.46) MEN1KMT2AMAPK1MAPTTP53
SCHEMBL17243251 0.79 JAK1 (0.46) MEN1KMT2AMAPK1MAPTTP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198256-A1 COMPOUNDS FOR THE DEGRADATION OF BRD9 OR MTH1 C4 THERAPEUTICS, INC. (US) 2021-07-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210198256-A1 COMPOUNDS FOR THE DEGRADATION OF BRD9 OR MTH1 RBBP9, MTHFD1, BRWD1 MEN1 238/4885KMT2A 2548/4885MAPK1 2873/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.